UCSF

ZINC33792634

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2009 28 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.20 8.6 -15.3 1 6 0 66 376.46 3
Lo Low (pH 4.5-6) 3.20 8.99 -54.83 2 6 1 67 377.468 3

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )